| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2011 | 19 | Yes |
Popular Name: (3S)-4-(2-furylmethyl)-3-[(1R)-1-pyrrolidin-1-ylethyl]-3H-1,2,4-triazol-5-one (3S)-4-(2-furylmethyl)-3-[(1R)-1…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 0.83 | 6.08 | -42.75 | 2 | 6 | 1 | 68 | 263.321 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.83 | 3.65 | -9.72 | 1 | 6 | 0 | 67 | 262.313 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
